(2-methoxy-6-methyl-pyrimidin-4-yl) 4-pentylbenzoate

Systemtic Name: (2-methoxy-6-methyl-pyrimidin-4-yl) 4-pentylbenzoate Openeye Name: (2-methoxy-6-methyl-pyrimidin-4-yl) 4-pentylbenzoate CAS Name: 4-pentylbenzoic acid (2-methoxy-6-methyl-4-pyrimidinyl) ester IUPAC Name: (2-methoxy-6-methylpyrimidin-4-yl) 4-pentylbenzoate Traditional Name: 4-amylbenzoic acid (2-methoxy-6-methyl-pyrimidin-4-yl) ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)OC2=NC(=NC(=C2)C)OC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)OC2=NC(=NC(=C2)C)OC

InChI

InChI=1S/C18H22N2O3/c1-4-5-6-7-14-8-10-15(11-9-14)17(21)23-16-12-13(2)19-18(20-16)22-3/h8-12H,4-7H2,1-3H3